SCHEMBL3458337

SCHEMBL3458337

NC(=O)c1cccn2nccc12

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 14/20 0.46
JAK1 P23458 14/20 0.46
TYK2 P29597 14/20 0.46
JAK3 P52333 14/20 0.46
PARP1 P09874 2/20 0.45
IRAK4 Q9NWZ3 1/20 0.43
MKNK1 Q9BUB5 1/20 0.41
ADRA1A P35348 1/20 0.41
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1892990 0.83 ALDH1A1 (0.43) KDM4EALDH1A1MAPTHPGDTSHR
SCHEMBL7381477 0.81 NPC1 (0.48) ADRA1AKDM4EALDH1A1MAPTHPGD
SCHEMBL9102971 0.81 JAK2 (0.43) JAK2JAK1TYK2JAK3PARP1
SCHEMBL25237331 0.79 JAK2 (0.38) JAK2JAK1TYK2JAK3PARP1
SCHEMBL8887417 0.77 LMNA (0.47) ADRA1AKDM4EALDH1A1MAPTTSHR
SCHEMBL11300658 0.76 EPHB3 (0.55) JAK2JAK1TYK2JAK3KDM4E
SCHEMBL12699179 0.74 JAK2 (0.56) JAK2JAK1TYK2JAK3
SCHEMBL9923339 0.74 JAK2 (0.58) JAK2JAK1TYK2JAK3
SCHEMBL25240695 0.74 JAK2 (0.35) JAK2JAK1TYK2JAK3PARP1
SCHEMBL25776500 0.74 JAK2 (0.42) JAK2JAK1TYK2JAK3IRAK4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2155744-A1 HETEROARYL AMIDE ANALOGUES AS P2X7 ANTAGONISTS Lundbeck, H., A/S (DK) 2010-02-24 EP claimed
WO-2008124153-A1 HETEROARYL AMIDE ANALOGUES AS P2X7 ANTAGONISTS H. LUNDBECK A/S (DK) 2008-10-16 WO claimed
US-20240076291-A1 MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-03-07 US disclosed
EP-4251149-A1 MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS Merck Sharp & Dohme LLC (US) 2023-10-04 EP disclosed
WO-2022115301-A1 MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2022-06-02 WO disclosed
US-8580812-B2 Heteroaryl amide analogues as P2X7 antagonists H. LUNDBECK A/S (DK) 2013-11-12 US disclosed
WO-2013067302-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2013-05-10 WO disclosed
US-20100266509-A1 HETEROARYL AMIDE ANALOGUES AS P2X7 ANTAGONISTS H. Lindbeck A/S (DK) 2010-10-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240076291-A1 MODIFIED ISOINDOLINONES AS GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GBA1, GBA2, ASAH2 JAK2 4615/4885JAK1 4800/4885TYK2 4594/4885
US-20100266509-A1 HETEROARYL AMIDE ANALOGUES AS P2X7 ANTAGONISTS P2RX7, P2RX3, P2RX2 JAK2 2312/4885JAK1 4017/4885TYK2 1454/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.